7-bromo-N-(2-methoxyphenyl)-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
7-bromo-N-(2-methoxyphenyl)-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
7-bromo-N-(2-methoxyphenyl)-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0271 |
| Compound Name: | 7-bromo-N-(2-methoxyphenyl)-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 462.34 |
| Molecular Formula: | C18 H12 Br N3 O3 S2 |
| Smiles: | COc1ccccc1NC(C1=C2NC(c3cc(ccc3N2C(=S)S1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7532 |
| logD: | 3.7532 |
| logSw: | -4.0941 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57 |
| InChI Key: | KYFRFGGPERMWMT-UHFFFAOYSA-N |